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We report the discovery of a geometric pathway for tuning ferroelectric properties through thermally driven reconfiguration between coexisting polar states in Li-substituted NaNbO3. Using first-principles density functional theory…

Structural, electronic and magnetic properties of polycrystalline La2-xCaxCoMnO6 (0 $\leq$ x $\leq$ 0.75) compounds are investigated by x-ray diffraction and magnetometry. All the samples have an orthorhombic structure and show a slight…

Materials Science · Physics 2022-05-11 J. R. Jesus , L. Bufaiçal , E. M. Bittar

In this study, we report the synthesis and characterization of a novel tetragonal polymorph of Tb-doped Pb2P2O7. Single-crystal X-ray diffraction confirms the stabilization of the P41 and P43 enantiomorphs at room temperature due to the…

Materials Science · Physics 2026-05-25 Yong Liu , Wenhua Bi , Alla Arakcheeva , Arnaud Magrez

Stereochemically active lone-pair (SCALP) cations are attractive units for realizing optical anisotropy. Antimony (III) chloride perovskites with SCALP have remained largely unknown till date. We synthesized vacancy ordered Cs3Sb2Cl9…

The coexistence of superconductivity and ferroelectricity is rare due to their conflicting requirements: superconductivity relies on free charge carriers, whereas ferroelectricity typically occurs in insulating systems. At LaAlO3/KTaO3…

Superconductivity · Physics 2025-06-23 Meng Zhang , Ming Qin , Yanqiu Sun , Siyuan Hong , Yanwu Xie

X-ray diffraction studies on a Pb(Zn$_{1/3}$Nb$_{2/3}$)O$_3$ (PZN) single crystal sample show the presence of two different structures. An outer-layer exists in the outer most $\sim$ 10 to 50~$\mu$m of the crystal, and undergoes a…

Materials Science · Physics 2009-11-10 Guangyong Xu , Z. Zhong , Y. Bing , Z. -G. Ye , C. Stock , G. Shirane

In contrast to ordinary ferroelectrics where the temperature, Tm, of the permittivity maximum monotonically increases with bias field, E, in (1-x)PbMg1/3Nb2/3O3-(x)PbTiO3 (0<x<0.35) single crystals, Tm was found to remain constant or…

Ferroelectricity usually fades away when materials are thinned down below a critical value. Employing the first-principles density functional theory and modern theory of polarization, we show that the unique ionic-potential anharmonicity…

Materials Science · Physics 2016-08-31 Ruixiang Fei , Wei Kang , Li Yang

The puzzling observation of room temperature ferromagnetism in double perovskites (A$_2$BB$'$O$_6$), despite having the magnetic lattice of B-ions diluted by non-magnetic B$'$-ions, have been examined for Sr$_2$FeReO$_6$. {\it Ab-initio}…

Strongly Correlated Electrons · Physics 2022-02-03 Shishir K. Pandey , Ashis K. Nandy , Poonam Kumari , Priya Mahadevan

First principle calculations are performed to investigate the effect of polar order strength on the thermoelectric (TE) properties of GeTe alloy in its rhombohedral structure. The variation in the polarization state using various…

Computational Physics · Physics 2026-01-06 Aida Sheibani , Charles Paillard , Abhyian Pandit , Raad Haleoot , Laurent Bellaiche , Bothina Hamad

The crystal structure of BiFeO3/BaxSr1-xTiO3 (BFO/BST) heterostructures with x = 0.2, 0.6 and 0.8, grown on single-crystal MgO (001) substrate was investigated by x-ray diffraction and Raman spectroscopy in order to determine the influence…

The temperature dependence of the electrical resistivity of the heterostructures consisting of single crystalline LaMnO$_3$ samples with different crystallographic orientations covered by the epitaxial ferroelectric…

Strongly Correlated Electrons · Physics 2017-10-20 D. P. Pavlov , I. I. Piyanzina , V. M. Mukhortov , A. M. Balbashov , D. A. Tayurskii , I. A. Garifullin , R. F. Mamin

In polar oxide interfaces phenomena such as conductivity, superconductivity, magnetism, one-dimensional conductivity and Quantum Hall states can emerge at the polar discontinuity. Combining controllable ferroelectricity at such interfaces…

Strongly Correlated Electrons · Physics 2020-07-06 Gal Tuvia , Yiftach Frenkel , Prasanna K. Rout , Itai Silber , Beena Kalisky , Yoram Dagan

Ferroelectric membranes transferred onto arbitrary substrates provide reduced mechanical clamping at the interfaces that can diminish the effective polarization-rotation barrier offering a pathway to engineer larger electromechanical and…

Epitaxial strain is a powerful means to engineer emergent phenomena in thin films and heterostructures. Here, we demonstrate that KTaO3, a cubic perovskite in bulk form, can be epitaxially strained into a highly tunable ferroelectric. KTaO3…

Two-dimensional ferroelectric monolayers are promising candidates for compact memory devices and flexible electronics. Here, through first-principles calculations, we predict room temperature ferroelectricity in AB-type monolayers…

Within the modified model of proton ordering of one-dimensional ferroelectric having hydrogen bonds of PbHPO$_4$-type, their thermodynamic and dynamic characteristics are studied and calculated taking into account the linear (by crystal…

Materials Science · Physics 2015-01-13 I. R. Zachek , R. R. Levitskii , Ya. Shchur , O. B. Bilenka

We have investigated magnetization(M), magnetocaloric effect(MCE) and magnetothermopower(MTEP) in polycrystalline Pr0.6Sr0.4MnO3, which shows a second-order paramagnetic to ferromagnetic transition near room temperature (TC = 305 K).…

Strongly Correlated Electrons · Physics 2012-10-19 D. V. Maheshwar Repaka , T. S. Tripathi , M. Aparnadevi , R. Mahendiran

This work addresses the effect of substituting Mn$^{3+}$ by Fe$^{3+}$ at the octahedral site of TbMnO$_3$ on the magnetic phase sequence, ferroelectric and magnetoelectric properties, keeping the Fe$^{3+}$ concentration below 5%. The…

Strongly Correlated Electrons · Physics 2017-05-29 R. Vilarinho , E. Queiros , D. J. Passos , D. A. Mota , P. B. Tavares , M. Mihalik , M. Zentkova , M. Mihalik , A. Almeida , J. Agostinho Moreira

We present the thermoelectric (TE) properties of LaCoO$_{3}$ compound in the temperature range 300-600 K. The experimental value of Seebeck coefficient ($\alpha$) at 300 K is found to be $\sim$635 $\mu$V/K. The value of $\alpha$ decreases…

Strongly Correlated Electrons · Physics 2017-04-25 Saurabh Singh , Sudhir K. Pandey
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